All tasks for computer 604303



State: All (13) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (2) · Invalid (0) · Error (11)
Application: All (13) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (4) · ATMbeta: Free energy calculations of protein-ligand binding (0) · ATMML: Free energy with neural networks (0) · LLM: LLMs for chemistry (0) · LLMS: LLMs for chemistry (Small) (0) · Quantum chemistry calculations on GPU (9)
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Show names		Work unit
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explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
38584094 31545093 16 Dec 2025, 13:34:57 UTC 16 Dec 2025, 13:37:21 UTC Error while computing 45.25 12.48 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581670 31545231 12 Dec 2025, 12:40:57 UTC 14 Dec 2025, 14:53:12 UTC Completed and validated 180,644.87 82,036.55 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581403 31545927 12 Dec 2025, 10:47:16 UTC 12 Dec 2025, 12:40:39 UTC Completed and validated 6,803.00 6,865.93 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580846 31545119 12 Dec 2025, 1:04:09 UTC 12 Dec 2025, 1:06:18 UTC Error while computing 46.25 11.61 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
33800893 27678270 2 Feb 2024, 12:12:47 UTC 2 Feb 2024, 12:31:16 UTC Error while computing 976.94 959.49 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800640 27678382 2 Feb 2024, 11:50:57 UTC 2 Feb 2024, 12:12:47 UTC Error while computing 1,213.62 1,198.66 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800616 27678456 2 Feb 2024, 11:47:47 UTC 2 Feb 2024, 11:50:57 UTC Error while computing 78.43 49.61 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800590 27678444 2 Feb 2024, 11:46:03 UTC 2 Feb 2024, 11:47:47 UTC Error while computing 34.45 0.14 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800444 27678317 2 Feb 2024, 11:31:41 UTC 2 Feb 2024, 11:35:05 UTC Error while computing 93.85 59.65 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800226 27678421 2 Feb 2024, 11:28:35 UTC 2 Feb 2024, 11:31:41 UTC Error while computing 75.81 49.98 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800148 27677871 2 Feb 2024, 11:01:54 UTC 2 Feb 2024, 11:28:35 UTC Error while computing 1,512.47 1,498.45 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33799478 27678210 2 Feb 2024, 9:25:30 UTC 2 Feb 2024, 9:36:31 UTC Error while computing 576.74 549.41 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33793486 27675367 1 Feb 2024, 18:36:27 UTC 1 Feb 2024, 18:59:26 UTC Error while computing 1,280.98 1,257.73 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu


State: All (13) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (2) · Invalid (0) · Error (11)
Application: All (13) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (4) · ATMbeta: Free energy calculations of protein-ligand binding (0) · ATMML: Free energy with neural networks (0) · LLM: LLMs for chemistry (0) · LLMS: LLMs for chemistry (Small) (0) · Quantum chemistry calculations on GPU (9)
Task name:



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